Chemical Properties of Fumaric acid, di(4-methylpent-2-yl) ester

InChI

InChI=1S/C16H28O4/c1-11(2)9-13(5)19-15(17)7-8-16(18)20-14(6)10-12(3)4/h7-8,11-14H,9-10H2,1-6H3/b8-7+

InChI Key

NZQQFMVULBBDSP-BQYQJAHWSA-N

Formula

C16H28O4

SMILES

CC(C)CC(C)OC(=O)C=CC(=O)OC(C)CC(C)C

Molecular Weight¹

284.39

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• η : Dynamic viscosity (Pa×s).
• Δ_fG° : Standard Gibbs free energy of formation (kJ/mol).
• Δ_fH°_gas : Enthalpy of formation at standard conditions (kJ/mol).
• Δ_fusH° : Enthalpy of fusion at standard conditions (kJ/mol).
• Δ_vapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
• log₁₀WS : Log10 of Water solubility in mol/l.
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• P_c : Critical Pressure (kPa).
• I_np : Non-polar retention indices.
• T_boil : Normal Boiling Point Temperature (K).
• T_c : Critical Temperature (K).
• T_fus : Normal melting (fusion) point (K).
• V_c : Critical Volume (m³/kmol).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
ΔfG°	-313.54	kJ/mol	Joback Calculated Property
ΔfH°gas	-767.07	kJ/mol	Joback Calculated Property
ΔfusH°	28.88	kJ/mol	Joback Calculated Property
ΔvapH°	67.93	kJ/mol	Joback Calculated Property
log10WS	-3.84		Crippen Calculated Property
logPoct/wat	3.498		Crippen Calculated Property
McVol	246.880	ml/mol	McGowan Calculated Property
Pc	1504.65	kPa	Joback Calculated Property
Inp	[1732.00; 1732.00]
Inp	1732.00		NIST
Inp	1732.00		NIST
Tboil	720.46	K	Joback Calculated Property
Tc	910.25	K	Joback Calculated Property
Tfus	349.32	K	Joback Calculated Property
Vc	0.935	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[712.39; 800.49]	J/mol×K	[720.46; 910.25]
Cp,gas	712.39	J/mol×K	720.46	Joback Calculated Property
Cp,gas	729.33	J/mol×K	752.09	Joback Calculated Property
Cp,gas	745.35	J/mol×K	783.72	Joback Calculated Property
Cp,gas	760.46	J/mol×K	815.36	Joback Calculated Property
Cp,gas	774.67	J/mol×K	846.99	Joback Calculated Property
Cp,gas	788.01	J/mol×K	878.62	Joback Calculated Property
Cp,gas	800.49	J/mol×K	910.25	Joback Calculated Property
η	[0.0000583; 0.0030382]	Pa×s	[349.32; 720.46]
η	0.0030382	Pa×s	349.32	Joback Calculated Property
η	0.0009576	Pa×s	411.18	Joback Calculated Property
η	0.0004082	Pa×s	473.03	Joback Calculated Property
η	0.0002119	Pa×s	534.89	Joback Calculated Property
η	0.0001261	Pa×s	596.75	Joback Calculated Property
η	0.0000827	Pa×s	658.60	Joback Calculated Property
η	0.0000583	Pa×s	720.46	Joback Calculated Property

Similar Compounds

Find more compounds similar to Fumaric acid, di(4-methylpent-2-yl) ester.

Sources

• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook

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